SCHEMBL3208489

SCHEMBL3208489

CCOC(=O)[C@@H](N[C]=O)C(C)C

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.38
GAA P10253 1/20 0.38
SI P14410 1/20 0.38
MGAM2 Q2M2H8 1/20 0.38
ALDH1A1 P00352 3/20 0.36
LMNA P02545 1/20 0.34
HSD17B10 Q99714 1/20 0.34
CA12 O43570 2/20 0.34
CA14 Q9ULX7 2/20 0.34
ALOX15 P16050 1/20 0.33
HTT P42858 1/20 0.33
HPGD P15428 1/20 0.33
SOAT1 P35610 1/20 0.33
CAD P27708 1/20 0.33
MMP8 P22894 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CA7 P43166 1/20 0.32
CA9 Q16790 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8610882 0.81 CA14 (0.52) GAAHSD17B10CA12CA14CA7
SCHEMBL3201070 0.81 CA14 (0.52) GAAHSD17B10CA12CA14CA7
SCHEMBL5650798 0.79 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1
SCHEMBL6315164 0.77 MGAM (0.42) MGAMGAASIMGAM2ALDH1A1
SCHEMBL3665543 0.77 MGAM (0.42) MGAMGAASIMGAM2ALDH1A1
SCHEMBL13108403 0.77 MGAM (0.42) MGAMGAASIMGAM2ALDH1A1
SCHEMBL23844118 0.75 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1
Hydrochloric Acid SCHEMBL19948891 0.75 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1
Hydrochloric Acid SCHEMBL6315156 0.75 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1
SCHEMBL7601776 0.75 MGAM (0.41) MGAMGAASIMGAM2ALDH1A1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7666866-B2 Antithrombotic diamides ELI LILLY AND COMPANY (US) 2010-02-23 US disclosed
EP-1819693-B1 ANTITHROMBOTIC DIAMIDES LILLY CO ELI (US) 2009-08-26 EP disclosed
US-20090062271-A1 Antithrombotic Diamides ELI LILLY AND COMPANY (US) 2009-03-05 US disclosed
EP-1819693-A1 ANTITHROMBOTIC DIAMIDES ELI LILLY AND COMPANY (US) 2007-08-22 EP disclosed
WO-2006057868-A1 ANTITHROMBOTIC DIAMIDES ELI LILLY AND COMPANY (US) 2006-06-01 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090062271-A1 Antithrombotic Diamides TFPI, SERPINC1, TFPI2 MGAM 1960/4885GAA 1186/4885SI 541/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.